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RCSB	
  Protein	
  Data	
  Bank	
  
1	
  
Founded in 1998
Rutgers, The State University of
New Jersey
•  Data deposition & annotation
UC San Diego,
San Diego Supercomputer Center
•  Data dissemination (rcsb.org)
Query, analysis, visualization,
web services, data download
wwPDB	
  
2	
  
Wellcome Trust,
EU,
CCP4, BBSRC,
MRC, EMBL
NLM BIRD-JST, MEXT
NSF, NIGMS, DOE,
NLM, NCI,
NINDS, NIDDK
wwPDB formed in 2003
•  Defines data and validation standards
•  Collects, annotates, validates and disseminates PDB data
RCSB	
  PDB	
  West	
  Team	
  
§  Science: structural and
computational biology,
structural bioinformatics,
chemoinformatics, genomics,
drug design, scientific software
development, research grants
§  Software: web design, user
experience design, database
design, web services, big data,
open source development
§  Systems: hardware,
networking, virtualization, cloud
computing, data management
3	
  
Scientists, software engineers,
postdocs, students
4	
  
Growing	
  User	
  Base	
  
Open	
  Source	
  Software	
  Development	
  
§ BioJava	
  (Sequence	
  and	
  Structure	
  modules)	
  
§  https://github.com/biojava	
  
§ RCSB	
  PDB	
  SpeciNic	
  Software	
  
§  https://github.com/rcsb	
  
	
  
§ Macromolecular	
  Transmission	
  Format	
  (MMTF)	
  
§  http://mmtf.rcsb.org	
  
6	
  

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SD CADD meeting: Introduction to the PDB

  • 1. RCSB  Protein  Data  Bank   1   Founded in 1998 Rutgers, The State University of New Jersey •  Data deposition & annotation UC San Diego, San Diego Supercomputer Center •  Data dissemination (rcsb.org) Query, analysis, visualization, web services, data download
  • 2. wwPDB   2   Wellcome Trust, EU, CCP4, BBSRC, MRC, EMBL NLM BIRD-JST, MEXT NSF, NIGMS, DOE, NLM, NCI, NINDS, NIDDK wwPDB formed in 2003 •  Defines data and validation standards •  Collects, annotates, validates and disseminates PDB data
  • 3. RCSB  PDB  West  Team   §  Science: structural and computational biology, structural bioinformatics, chemoinformatics, genomics, drug design, scientific software development, research grants §  Software: web design, user experience design, database design, web services, big data, open source development §  Systems: hardware, networking, virtualization, cloud computing, data management 3   Scientists, software engineers, postdocs, students
  • 6. Open  Source  Software  Development   § BioJava  (Sequence  and  Structure  modules)   §  https://github.com/biojava   § RCSB  PDB  SpeciNic  Software   §  https://github.com/rcsb     § Macromolecular  Transmission  Format  (MMTF)   §  http://mmtf.rcsb.org   6